Methyl 2-(cyclopentylamino)acetate hydrochloride - ≥95% , CAS No.195877-46-4

CAS: 195877-46-4 Cat. No.: M191861 Peso molecular: 193.67

GRADE & PURITY ≥95%

Synonyms

HY-W003871 | METHYL 2-(CYCLOPENTYLAMINO)ACETATE HCL | FT-0755413 | Methyl N-cyclopentylglycinate hydrochloride (1:1) | methyl 2-(cyclopentylamino)acetate;hydrochloride | METHYL 2-(CYCLOPENTYLAMINO)ACETATE HYDROCHLORIDE | DTXSID10700140 | Glycine, N-cyclop

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

HY-W003871 | METHYL 2-(CYCLOPENTYLAMINO)ACETATE HCL | FT-0755413 | Methyl N-cyclopentylglycinate hydrochloride (1:1) | methyl 2-(cyclopentylamino)acetate;hydrochloride | METHYL 2-(CYCLOPENTYLAMINO)ACETATE HYDROCHLORIDE | DTXSID10700140 | Glycine, N-cyclop

Especificaciones y pureza

≥95%

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥95%

Nombres e identificadores

• Pubchem Sid: 488201629
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488201629
• Sonrisas canónicas: COC(=O)CNC1CCCC1.Cl
• IUPAC Name: methyl 2-(cyclopentylamino)acetate;hydrochloride
• InChIKey: MNXDQYYCGFEEHQ-UHFFFAOYSA-N
• INCHI: 1S/C8H15NO2.ClH/c1-11-8(10)6-9-7-4-2-3-5-7;/h7,9H,2-6H2,1H3;1H
• Isómeros SMILES: COC(=O)CNC1CCCC1.Cl
• CAS alternativo: 190904-15-5
• Peso molecular: 193.67
• Reaxy-Rn: 8079008
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=8079008&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Clase Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Level5 Amino acids and derivatives
          • Level6 Alpha amino acids and derivatives
            • Level7 Alpha amino acid esters

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Clase: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Amino acids and derivatives - Alpha amino acids and derivatives
• Direct Parent: Alpha amino acid esters
• Alternative Parents: Methyl esters Monocarboxylic acids and derivatives Dialkylamines Organopnictogen compounds Organic oxides Hydrochlorides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Alpha-amino acid ester - Methyl ester - Carboxylic acid ester - Secondary aliphatic amine - Monocarboxylic acid or derivatives - Secondary amine - Organic nitrogen compound - Hydrochloride - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organopnictogen compound - Organic oxygen compound - Carbonyl group - Amine - Aliphatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as alpha amino acid esters. These are ester derivatives of alpha amino acids.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Propiedades químicas y físicas

• Peso molecular: 193.670 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 193.087 Da
• Monoisotopic Mass: 193.087 Da
• Topological Polar Surface Area: 38.300 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 130.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 2

XLogP3